N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-3-cyano-benzenesulfonamide

Systemtic Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-3-cyano-benzenesulfonamide Openeye Name: 3-cyano-N-[(3R)-quinuclidin-1-ium-3-yl]benzenesulfonamide CAS Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-3-cyanobenzenesulfonamide IUPAC Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-3-cyanobenzenesulfonamide Traditional Name: 3-cyano-N-[(3R)-quinuclidin-1-ium-3-yl]benzenesulfonamide Formula: C14H18N3O2S+ MolecularWeight: 292.37662

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)NS(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1C[NH+]2CCC1[C@H](C2)NS(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C14H17N3O2S/c15-9-11-2-1-3-13(8-11)20(18,19)16-14-10-17-6-4-12(14)5-7-17/h1-3,8,12,14,16H,4-7,10H2/p+1/t14-/m0/s1